#------------------------------------------------------------------------------ #$Date: 2015-10-10 06:32:55 +0300 (Sat, 10 Oct 2015) $ #$Revision: 164718 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/68/1536836.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1536836 loop_ _publ_author_name 'Kokunov, Yu.V.' 'Aslanov, L.A.' 'Rakov, I.E.' 'Yatsenko, A.V.' 'Buslaev, Yu.A.' _publ_section_title ; Synthesis and crystal structure of tin(II) fluorosulfate hydrate ; _journal_name_full 'Doklady Akademii Nauk SSSR' _journal_page_first 119 _journal_page_last 123 _journal_volume 318 _journal_year 1991 _chemical_formula_sum 'F2 H2 O5 S Sn2' _chemical_name_systematic 'Sn2 F2 S O4 H2 O' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2ybc' _symmetry_space_group_name_H-M 'P 1 21/c 1' _cell_angle_alpha 90 _cell_angle_beta 90.97 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 6.982 _cell_length_b 12.881 _cell_length_c 7.228 _cell_volume 649.958 _citation_journal_id_ASTM DANKAS _cod_data_source_file Kokunov_DANKAS_1991_1164.cif _cod_data_source_block H2F2O5S1Sn2 _cod_chemical_formula_sum_orig 'H2 F2 O5 S1 Sn2' _cod_database_code 1536836 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y+1/2,-z+1/2 -x,-y,-z x,-y-1/2,z-1/2 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv Sn2 Sn+2 0.761 0.01947 0.1701 1 0.0 S1 S+6 0.7563 -0.0813 0.7283 1 0.0 F1 F-1 0.741 0.3626 0.4649 1 0.0 H2 H+1 0.051 0.231 0.728 1 0.0 O3 O-2 0.753 0.0063 0.592 1 0.0 O4 O-2 0.583 -0.0831 0.836 1 0.0 Sn1 Sn+2 0.6771 0.18035 0.6528 1 0.0 F2 F-1 0.7677 0.3376 0.8398 1 0.0 O2 O-2 0.918 -0.0652 0.8398 1 0.0 O1 O-2 0.786 -0.1797 0.631 1 0.0 O5 O-2 0.989 0.1853 0.667 1 0.0 H1 H+1 0.051 0.186 0.571 1 0.0